Geometry & MOs

Info

ID:

215010

PubChem CID:

85083989

Reduced:

BrSiO4C37H49 (1)

Stoich.:

ABC4D37E49 (1)

Weight, g/mol:

665.267191

ΔHf, kcal/mol:

-203.48

Dipole, Da:

4.67

IP(EA), eV:

 -8.95(-0.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[[2-[(2-amino-3-thiophen-2-ylpropanoyl)amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-naphthalen-2-ylpropanoyl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC(C(C2C1C(C(C=C2Br)C(=CCOC(=O)C)C)(C)C(=O)C)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)C

DOS

IR

Vibrations