Geometry & MOs

Info

ID:	52322
PubChem CID:	12015149
Reduced:	NOF2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	201.115364
ΔH_f, kcal/mol:	-153.66
Dipole, Da:	2.32
IP(EA), eV:	-9.61(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-4-phenylcyclohexane-1-carbonitrile

Drug info:

PubChemData

Smile

CC1=CCC2C(C1)C(=O)N(C2(F)F)C

DOS

IR

Vibrations