Geometry & MOs

Info

ID:	255961
PubChem CID:	103135919
Reduced:	NC9H9 (2)
Stoich.:	AB9C9 (2)
Weight, g/mol:	254.178299
ΔH_f, kcal/mol:	59.57
Dipole, Da:	2.49
IP(EA), eV:	-9.07(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[isoquinolin-8-yl-(2-methylcyclopropyl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(C2=CC=CC3=C2C=NC=C3)N)C

DOS

IR

Vibrations