Geometry & MOs

Info

ID:	242032
PubChem CID:	96025161
Reduced:	NC15H21 (1)
Stoich.:	AB15C21 (1)
Weight, g/mol:	217.18305
ΔH_f, kcal/mol:	5.06
Dipole, Da:	2.1
IP(EA), eV:	-8.67(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-tert-butyl-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations