Geometry & MOs

Info

ID:	222019
PubChem CID:	85293429
Reduced:	ClNO4C27H28 (1)
Stoich.:	ABC4D27E28 (1)
Weight, g/mol:	466.267902
ΔH_f, kcal/mol:	-81.25
Dipole, Da:	4.67
IP(EA), eV:	-8.3(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyethoxy)ethyl 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(C)N(CC(COC1=CC=CC=C1CC=C)O)C=CC2=C(C(=O)C3=CC=CC=C3C2=O)Cl

DOS

IR

Vibrations