Geometry & MOs

Info

ID:

447427

PubChem CID:

135282824

Reduced:

SO2N6C29H30 (1)

Stoich.:

AB2C6D29E30 (1)

Weight, g/mol:

487.268236

ΔHf, kcal/mol:

43.23

Dipole, Da:

5.74

IP(EA), eV:

 -8.34(-0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[4-[(2S,4S)-5-amino-2,4-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonyl]pentoxy]-3-(hydroxymethyl)phenyl]pyridin-2-yl]-methylcarbamic acid

Drug info:

PubChemData

Smile

CC(=C)CNCCOC(=O)NCC1=CC=C(C=C1)CN2C3=C(C(=NC4=CC=CC=C43)N)N=C2C5=CSC=C5

DOS

IR

Vibrations