Geometry & MOs

Info

ID:	341053
PubChem CID:	127263488
Reduced:	NOS2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	287.1333
ΔH_f, kcal/mol:	-54.99
Dipole, Da:	4.19
IP(EA), eV:	-8.98(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC12CCC(CC13SCCS3)NC2=O

DOS

IR

Vibrations