Geometry & MOs

Info

ID:	242006
PubChem CID:	96025037
Reduced:	NC16H21 (1)
Stoich.:	AB16C21 (1)
Weight, g/mol:	253.146664
ΔH_f, kcal/mol:	24.07
Dipole, Da:	2.48
IP(EA), eV:	-8.7(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(E)-2-(furan-2-yl)ethenyl]-7,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

C/C=C/C=C/[C@H]1C2=C(CCN1)C=CC(=C2C)C

DOS

IR

Vibrations