Geometry & MOs

Info

ID:	241125
PubChem CID:	96021347
Reduced:	NC15H19 (1)
Stoich.:	AB15C19 (1)
Weight, g/mol:	225.126598
ΔH_f, kcal/mol:	30.03
Dipole, Da:	1.96
IP(EA), eV:	-8.78(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-8-methyl-1-pyrazin-2-yl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

C/C=C/C=C/[C@H]1C2=C(CCN1)C=C(C=C2)C

DOS

IR

Vibrations