Geometry & MOs

Info

ID:	136369
PubChem CID:	52029932
Reduced:	N3O4C24H27 (1)
Stoich.:	A3B4C24D27 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-104.38
Dipole, Da:	3.51
IP(EA), eV:	-8.49(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylphenyl)-3-(6-oxo-2-phenyl-4-propylpyrimidin-1-yl)propanamide

Drug info:

PubChemData

Smile

CCC1=CC(=O)N(C(=N1)C2=CC=CC=C2)CCC(=O)NCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations