Geometry & MOs

Info

ID:	148566
PubChem CID:	53788233
Reduced:	N2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	228.101111
ΔH_f, kcal/mol:	15.86
Dipole, Da:	1.91
IP(EA), eV:	-8.21(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methyl-3H-benzimidazol-5-yl)-4,5-dihydro-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CN2)CC3CCNCC3

DOS

IR

Vibrations