Geometry & MOs

Info

ID:	68512
PubChem CID:	46508559
Reduced:	SN2O7C23H28 (1)
Stoich.:	AB2C7D23E28 (1)
Weight, g/mol:	420.204907
ΔH_f, kcal/mol:	-267.99
Dipole, Da:	8.66
IP(EA), eV:	-8.89(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)OCC

DOS

IR

Vibrations