Geometry & MOs

Info

ID:	129556
PubChem CID:	51073076
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-42.71
Dipole, Da:	3.03
IP(EA), eV:	-9.32(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCOCC3

DOS

IR

Vibrations