Geometry & MOs

Info

ID:	172234
PubChem CID:	75482972
Reduced:	ON2C16H32 (1)
Stoich.:	AB2C16D32 (1)
Weight, g/mol:	288.183778
ΔH_f, kcal/mol:	-81.63
Dipole, Da:	1.32
IP(EA), eV:	-8.41(2.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-methoxypropan-2-ylamino)cyclohexyl]oxybenzonitrile

Drug info:

PubChemData

Smile

CC(C)C(C)NCC1(CCOCC1)N2CCCCC2

DOS

IR

Vibrations