Geometry & MOs

Info

ID:	241713
PubChem CID:	96024062
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	279.1987
ΔH_f, kcal/mol:	-94.87
Dipole, Da:	5.17
IP(EA), eV:	-9.16(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-7,8-dimethyl-1-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H](NCC2)[C@H](C)C(=O)O

DOS

IR

Vibrations