Geometry & MOs

Info

ID:	41448
PubChem CID:	8145902
Reduced:	N4O4C19H26 (1)
Stoich.:	A4B4C19D26 (1)
Weight, g/mol:	395.163377
ΔH_f, kcal/mol:	-128.17
Dipole, Da:	1.14
IP(EA), eV:	-8.71(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(Z)-anthracen-9-ylmethylideneamino]-N-[(4-methylphenyl)methyl]oxamide

Drug info:

PubChemData

Smile

CCC[C@@H]1C(=O)N(C(=O)N1)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations