Geometry & MOs

Info

ID:	14747
PubChem CID:	419418
Reduced:	N3O3C28H33 (1)
Stoich.:	A3B3C28D33 (1)
Weight, g/mol:	459.252192
ΔH_f, kcal/mol:	-51.89
Dipole, Da:	3.77
IP(EA), eV:	-8.3(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-2-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C2N(CCCN2CC3=CC=C(C=C3)OC)CC4=CC=C(C=C4)OC

DOS

IR

Vibrations