Geometry & MOs

Info

ID:	267719
PubChem CID:	103586000
Reduced:	OF2N2C14H20 (1)
Stoich.:	AB2C2D14E20 (1)
Weight, g/mol:	296.17002
ΔH_f, kcal/mol:	-146.43
Dipole, Da:	2.63
IP(EA), eV:	-8.95(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(aminomethyl)-N-(2,5-difluoro-4-methylphenyl)-4-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)NC(=O)C(CC(C)C)CN)F

DOS

IR

Vibrations