Geometry & MOs

Info

ID:	75621
PubChem CID:	48423751
Reduced:	ClNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	384.168522
ΔH_f, kcal/mol:	-104.92
Dipole, Da:	1.0
IP(EA), eV:	-8.89(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(1,3-benzodioxol-5-ylmethoxy)pyridin-4-yl]methyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=C(C=CC(=C1)Cl)OC)OCC2CC2

DOS

IR

Vibrations