Geometry & MOs

Info

ID:	241240
PubChem CID:	96022174
Reduced:	NF2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	265.164206
ΔH_f, kcal/mol:	-175.46
Dipole, Da:	5.06
IP(EA), eV:	-9.29(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-6,8-difluoro-1-(2,2,3,3-tetramethylcyclopropyl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC(C)(C[C@@H]1C2=C(CCN1)C=C(C=C2F)F)C(=O)O

DOS

IR

Vibrations