Geometry & MOs

Info

ID:	122603
PubChem CID:	50813928
Reduced:	N3O3C27H29 (1)
Stoich.:	A3B3C27D29 (1)
Weight, g/mol:	429.205242
ΔH_f, kcal/mol:	-73.76
Dipole, Da:	9.63
IP(EA), eV:	-8.62(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-[(3-methoxyphenyl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2CCCN(C2=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)CCO

DOS

IR

Vibrations