Geometry & MOs

Info

ID:	362885
PubChem CID:	127309714
Reduced:	ClO2N4C20H27 (1)
Stoich.:	AB2C4D20E27 (1)
Weight, g/mol:	385.119319
ΔH_f, kcal/mol:	-77.68
Dipole, Da:	4.01
IP(EA), eV:	-8.97(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]-3-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NC3CCN(C3=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations