Geometry & MOs

Info

ID:	157707
PubChem CID:	56436641
Reduced:	O3N5C22H27 (1)
Stoich.:	A3B5C22D27 (1)
Weight, g/mol:	427.221954
ΔH_f, kcal/mol:	-91.86
Dipole, Da:	4.68
IP(EA), eV:	-8.45(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-3-[[[3-[(2-methoxyacetyl)amino]phenyl]carbamoylamino]methyl]benzamide

Drug info:

PubChemData

Smile

CN(C)CCNC(=O)C1=CC=CC(=C1)CNC(=O)NC2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations