Geometry & MOs

Info

ID:	387775
PubChem CID:	134986863
Reduced:	SC4H9 (2)
Stoich.:	AB4C9 (2)
Weight, g/mol:	185.120449
ΔH_f, kcal/mol:	-32.78
Dipole, Da:	2.75
IP(EA), eV:	-8.48(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-1-propylisoquinoline

Drug info:

PubChemData

Smile

CCCC(SC)SC(C)C

DOS

IR

Vibrations