Geometry & MOs

Info

ID:	157709
PubChem CID:	56436643
Reduced:	O3N5C26H35 (1)
Stoich.:	A3B5C26D35 (1)
Weight, g/mol:	425.24269
ΔH_f, kcal/mol:	-96.2
Dipole, Da:	8.24
IP(EA), eV:	-9.04(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-3-[[[4-(propan-2-ylcarbamoyl)phenyl]carbamoylamino]methyl]benzamide

Drug info:

PubChemData

Smile

CN(C)CCNC(=O)C1=CC=CC(=C1)CNC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3

DOS

IR

Vibrations