Geometry & MOs

Info

ID:	157548
PubChem CID:	56435656
Reduced:	OSN5C16H25 (1)
Stoich.:	ABC5D16E25 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	8.91
Dipole, Da:	2.9
IP(EA), eV:	-8.88(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-4-oxo-4-phenylbutanamide

Drug info:

PubChemData

Smile

CCC1=C(SN=N1)C(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations