Geometry & MOs

Info

ID:	157921
PubChem CID:	56459016
Reduced:	N3O3H19C23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	408.252526
ΔH_f, kcal/mol:	-33.46
Dipole, Da:	6.34
IP(EA), eV:	-8.89(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC3=CC=CC=C3C=C2C(=O)NC4=CC5=C(C=C4)OC(=O)C=C5

DOS

IR

Vibrations