Geometry & MOs

Info

ID:	62952
PubChem CID:	26737769
Reduced:	O3N5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	371.073991
ΔH_f, kcal/mol:	27.0
Dipole, Da:	9.13
IP(EA), eV:	-8.88(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(2-methyl-3-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)/C=C/C(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C

DOS

IR

Vibrations