Geometry & MOs

Info

ID:	364835
PubChem CID:	127316276
Reduced:	O2N6C21H28 (1)
Stoich.:	A2B6C21D28 (1)
Weight, g/mol:	312.043233
ΔH_f, kcal/mol:	-38.19
Dipole, Da:	5.55
IP(EA), eV:	-8.72(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(4,5-dichloro-2,3-dihydro-1H-inden-1-yl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N2CCN(CC2)CC3=NC=CN3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations