Geometry & MOs

Info

ID:	274365
PubChem CID:	103808803
Reduced:	FN2O2C16H17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-88.41
Dipole, Da:	4.97
IP(EA), eV:	-8.9(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-(3-methoxyphenyl)ethyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCNC(=O)C2=CC(=C(C=C2)F)N

DOS

IR

Vibrations