Geometry & MOs

Info

ID:	241847
PubChem CID:	96024394
Reduced:	NC16H23 (1)
Stoich.:	AB16C23 (1)
Weight, g/mol:	229.18305
ΔH_f, kcal/mol:	-13.42
Dipole, Da:	1.3
IP(EA), eV:	-8.82(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-cyclopentyl-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C(C2=C(CCN[C@@H]2C3CCCC3)C=C1)C

DOS

IR

Vibrations