Geometry & MOs

Info

ID:	241996
PubChem CID:	96024990
Reduced:	ON2C19H22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	277.157898
ΔH_f, kcal/mol:	-25.76
Dipole, Da:	2.82
IP(EA), eV:	-8.65(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(3H-benzimidazol-5-yl)-7,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations