Geometry & MOs

Info

ID:	323353
PubChem CID:	126674468
Reduced:	FNO3C23H28 (1)
Stoich.:	ABC3D23E28 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	-167.91
Dipole, Da:	1.49
IP(EA), eV:	-9.04(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(1R)-1-amino-2,3-dihydro-1H-inden-4-yl]-3,5-dimethylphenyl]methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C2=C3CC[C@H](C3=C(C=C2)F)N)C)OCC4(CCOCC4)O

DOS

IR

Vibrations