Geometry & MOs

Info

ID:	241153
PubChem CID:	96021556
Reduced:	NF2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	285.132906
ΔH_f, kcal/mol:	-45.56
Dipole, Da:	1.92
IP(EA), eV:	-9.27(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(E)-2-(2,5-difluorophenyl)ethenyl]-6-methyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

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CC1=C2[C@@H](NCCC2=CC=C1)/C=C/C3=C(C=CC(=C3)F)F

DOS

IR

Vibrations