Geometry & MOs

Info

ID:	369844
PubChem CID:	127336438
Reduced:	N2O4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	-117.75
Dipole, Da:	2.74
IP(EA), eV:	-9.36(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-1,3-benzodioxole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)C3=CC4=C(COC4)C=C3

DOS

IR

Vibrations