Geometry & MOs

Info

ID:	367682
PubChem CID:	127325390
Reduced:	O2N6C19H32 (1)
Stoich.:	A2B6C19D32 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-63.24
Dipole, Da:	4.19
IP(EA), eV:	-8.67(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-methylcyclohexyl)acetyl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(NN=C1C(=O)N(C)C2CCN(CC2)CC(=O)N3CCN(CC3)C)C

DOS

IR

Vibrations