Geometry & MOs

Info

ID:	173663
PubChem CID:	75666934
Reduced:	O3N6C20H25 (1)
Stoich.:	A3B6C20D25 (1)
Weight, g/mol:	362.220557
ΔH_f, kcal/mol:	-64.06
Dipole, Da:	3.08
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.051378
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-N-(2-methyl-2-morpholin-4-ylpropyl)-5-prop-1-enylbenzamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2C=CC=CC2=[N+](C1=O)CC(=O)NCC3=NN=C4N3CCCCC4

DOS

IR

Vibrations