Geometry & MOs

Info

ID:	136879
PubChem CID:	52117744
Reduced:	O2N3C24H27 (1)
Stoich.:	A2B3C24D27 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-33.89
Dipole, Da:	7.18
IP(EA), eV:	-8.96(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1-yl]-N-[2-(4-methylphenyl)ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CCNC(=O)CCN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)C)C

DOS

IR

Vibrations