Geometry & MOs

Info

ID:	336443
PubChem CID:	127255450
Reduced:	N2O7C32H36 (1)
Stoich.:	A2B7C32D36 (1)
Weight, g/mol:	558.236601
ΔH_f, kcal/mol:	-250.92
Dipole, Da:	3.93
IP(EA), eV:	-8.83(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,4-dimethoxyphenyl)methyl-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopentanecarbonyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N(CC1=C(C=C(C=C1)OC)OC)CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

DOS

IR

Vibrations