Geometry & MOs

Info

ID:	277548
PubChem CID:	103829341
Reduced:	ClSN2H13C14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	162.060469
ΔH_f, kcal/mol:	47.29
Dipole, Da:	3.89
IP(EA), eV:	-8.58(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(N2C(=C(SC2=N1)C)C)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations