Geometry & MOs

Info

ID:	55587
PubChem CID:	17395601
Reduced:	ON4C16H22 (1)
Stoich.:	AB4C16D22 (1)
Weight, g/mol:	439.129884
ΔH_f, kcal/mol:	-5.69
Dipole, Da:	3.02
IP(EA), eV:	-8.32(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-(1H-indol-3-yl)propanoate

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=CC(=O)N3C=C(C=CC3=N2)C

DOS

IR

Vibrations