Geometry & MOs

Info

ID:	69265
PubChem CID:	46530546
Reduced:	N5O5C23H25 (1)
Stoich.:	A5B5C23D25 (1)
Weight, g/mol:	352.142307
ΔH_f, kcal/mol:	-141.73
Dipole, Da:	5.54
IP(EA), eV:	-8.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]methyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=CC=C(C=C2)NC(=O)NCC=C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations