Geometry & MOs

Info

ID:	273067
PubChem CID:	103770432
Reduced:	BrNSF2O2C8H8 (1)
Stoich.:	ABCD2E2F8G8 (1)
Weight, g/mol:	273.11765
ΔH_f, kcal/mol:	-153.99
Dipole, Da:	4.63
IP(EA), eV:	-9.91(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-4-propoxybenzamide

Drug info:

PubChemData

Smile

C1=C(SC(=C1)Br)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations