Geometry & MOs

Info

ID:	413002
PubChem CID:	135085946
Reduced:	NOSF3C8H14 (1)
Stoich.:	ABCD3E8F14 (1)
Weight, g/mol:	234.100442
ΔH_f, kcal/mol:	-202.3
Dipole, Da:	2.78
IP(EA), eV:	-8.71(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[(4-hydroxyphenyl)methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC/C(=N\[S@](=O)C(C)(C)C)/C(F)(F)F

DOS

IR

Vibrations