Geometry & MOs

Info

ID:	55364
PubChem CID:	17395292
Reduced:	NO6C19H21 (1)
Stoich.:	AB6C19D21 (1)
Weight, g/mol:	314.126657
ΔH_f, kcal/mol:	-215.11
Dipole, Da:	6.53
IP(EA), eV:	-9.2(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-ylamino)-N-(2-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(O1)CO)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C(C)C

DOS

IR

Vibrations