Geometry & MOs

Info

ID:	202454
PubChem CID:	79674275
Reduced:	ON3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	12.67
Dipole, Da:	5.95
IP(EA), eV:	-8.88(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,5-dimethylcyclohexyl)morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1N2CCOC(C2)C#N)N

DOS

IR

Vibrations