Geometry & MOs

Info

ID:	320499
PubChem CID:	126661463
Reduced:	N2C9H20 (1)
Stoich.:	A2B9C20 (1)
Weight, g/mol:	303.104148
ΔH_f, kcal/mol:	-7.27
Dipole, Da:	1.54
IP(EA), eV:	-8.27(3.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,6-diazabicyclo[3.2.0]heptan-3-ylsulfinyl)-4-methoxyisoquinoline

Drug info:

PubChemData

Smile

CC1CNCCCCN(C1)C

DOS

IR

Vibrations