Geometry & MOs

Info

ID:	416844
PubChem CID:	135090581
Reduced:	FO2N5C19H24 (1)
Stoich.:	AB2C5D19E24 (1)
Weight, g/mol:	357.194008
ΔH_f, kcal/mol:	-66.36
Dipole, Da:	3.96
IP(EA), eV:	-9.15(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R,4S)-4-hydroxy-3-methoxy-N-[(4-methoxynaphthalen-1-yl)methyl]-N-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CN1C(=O)C=C(C=N1)N2CCN(CC2)C(=O)CN(C)CC3=CC=C(C=C3)F

DOS

IR

Vibrations