Geometry & MOs

Info

ID:	255486
PubChem CID:	103132409
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	240.162649
ΔH_f, kcal/mol:	-83.46
Dipole, Da:	5.65
IP(EA), eV:	-9.56(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-isoquinolin-8-yl-4-methylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCCC1CCC(C(C1)C2=NN(C=C2)C)C(=O)O

DOS

IR

Vibrations