Geometry & MOs

Info

ID:	241890
PubChem CID:	96024510
Reduced:	N2C19H24 (1)
Stoich.:	A2B19C24 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	24.2
Dipole, Da:	3.43
IP(EA), eV:	-8.77(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-7,8-dimethyl-1-(phenylmethoxymethyl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H](NCC2)CNCC3=CC=CC=C3

DOS

IR

Vibrations