Geometry & MOs

Info

ID:	257083
PubChem CID:	103143651
Reduced:	N3C18H25 (1)
Stoich.:	A3B18C25 (1)
Weight, g/mol:	283.204848
ΔH_f, kcal/mol:	31.59
Dipole, Da:	3.4
IP(EA), eV:	-8.65(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[amino(isoquinolin-8-yl)methyl]-N,N-dimethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C(C1=CC=CC2=C1C=NC=C2)N)N3CCCCC3

DOS

IR

Vibrations