Geometry & MOs

Info

ID:	401133
PubChem CID:	135050264
Reduced:	INO2C20H38 (1)
Stoich.:	ABC2D20E38 (1)
Weight, g/mol:	195.1987
ΔH_f, kcal/mol:	-118.58
Dipole, Da:	5.19
IP(EA), eV:	-9.77(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-propylcyclohexen-1-amine

Drug info:

PubChemData

Smile

CC(OC)OC(CCCCCCCCCCCCCCCI)C#N

DOS

IR

Vibrations