Geometry & MOs

Info

ID:	273058
PubChem CID:	103770407
Reduced:	NSF2O2C13H17 (1)
Stoich.:	ABC2D2E13F17 (1)
Weight, g/mol:	292.9863
ΔH_f, kcal/mol:	-189.88
Dipole, Da:	6.34
IP(EA), eV:	-8.88(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(3,3-difluoro-2-hydroxypropyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)SCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations