Geometry & MOs

Info

ID:	369133
PubChem CID:	127331365
Reduced:	NSO2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	-61.48
Dipole, Da:	5.11
IP(EA), eV:	-8.41(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(dicyclopropylmethyl)-1-ethyl-N-methyl-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCOC1)C(=O)C2CSC3=CC=CC=C23

DOS

IR

Vibrations