Geometry & MOs

Info

ID:	342986
PubChem CID:	127266149
Reduced:	O2N3C16H17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	298.168128
ΔH_f, kcal/mol:	-25.16
Dipole, Da:	7.8
IP(EA), eV:	-8.87(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(1-methylcyclohexyl)-4-oxoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CCC(CC#N)NC(=O)C1=CC(=O)C2=CC=CC=C2N1C

DOS

IR

Vibrations