Geometry & MOs

Info

ID:	62038
PubChem CID:	26717177
Reduced:	ClN2O7H17C24 (1)
Stoich.:	AB2C7D17E24 (1)
Weight, g/mol:	365.162708
ΔH_f, kcal/mol:	-113.97
Dipole, Da:	6.34
IP(EA), eV:	-8.88(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5-trimethoxy-N-[(1S)-1-naphthalen-2-ylethyl]benzamide

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)/C=C/C(=O)OC3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

DOS

IR

Vibrations