Geometry & MOs

Info

ID:	78726
PubChem CID:	49703952
Reduced:	ON2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	353.119798
ΔH_f, kcal/mol:	8.18
Dipole, Da:	6.17
IP(EA), eV:	-9.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)-N-(thiophen-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NCC1=CN=CC=C1)N2C(=O)C=CC(=N2)C3=CC=CC=C3

DOS

IR

Vibrations