Geometry & MOs

Info

ID:	173180
PubChem CID:	75607780
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	328.088164
ΔH_f, kcal/mol:	-87.43
Dipole, Da:	6.15
IP(EA), eV:	-9.86(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2,5-dioxo-7-thiophen-2-yl-4a,6,7,8-tetrahydroquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCC2C(C1)CC(C(=O)N2)C(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations