Geometry & MOs

Info

ID:	256799
PubChem CID:	103141478
Reduced:	SN3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	80.22
Dipole, Da:	2.68
IP(EA), eV:	-8.99(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[isoquinolin-8-yl-(1-methylcyclopentyl)methyl]hydrazine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations