Geometry & MOs

Info

ID:	56429
PubChem CID:	17425427
Reduced:	O2N4H16C17 (1)
Stoich.:	A2B4C16D17 (1)
Weight, g/mol:	345.071802
ΔH_f, kcal/mol:	0.52
Dipole, Da:	2.87
IP(EA), eV:	-8.0(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

DOS

IR

Vibrations