Geometry & MOs

Info

ID:	242038
PubChem CID:	96025194
Reduced:	NF2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	273.132906
ΔH_f, kcal/mol:	-65.17
Dipole, Da:	4.95
IP(EA), eV:	-9.0(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(2,3-difluorophenyl)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

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

DOS

IR

Vibrations