Geometry & MOs

Info

ID:	153009
PubChem CID:	56312121
Reduced:	OSN2C21H26 (1)
Stoich.:	ABC2D21E26 (1)
Weight, g/mol:	400.15537
ΔH_f, kcal/mol:	15.15
Dipole, Da:	5.33
IP(EA), eV:	-8.5(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[cyclopropylmethyl(1-phenylethyl)amino]acetamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N(CC2CC2)CC(=O)NC3=CC=C(C=C3)SC

DOS

IR

Vibrations