Geometry & MOs

Info

ID:	78923
PubChem CID:	49742710
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	358.121195
ΔH_f, kcal/mol:	-70.61
Dipole, Da:	2.58
IP(EA), eV:	-8.98(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methyltetrazol-5-yl)sulfanyl-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)COC3=CN=CC=C3

DOS

IR

Vibrations