Geometry & MOs

Info

ID:	256000
PubChem CID:	103136214
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	268.193949
ΔH_f, kcal/mol:	-36.16
Dipole, Da:	4.27
IP(EA), eV:	-9.16(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-1-isoquinolin-8-yl-N-methylethanamine

Drug info:

PubChemData

Smile

CC1CCC(O1)CN2C=C(C3=C2N=CC=C3)C=O

DOS

IR

Vibrations