Geometry & MOs

Info

ID:	157584
PubChem CID:	56435875
Reduced:	N3O3C25H35 (1)
Stoich.:	A3B3C25D35 (1)
Weight, g/mol:	373.21139
ΔH_f, kcal/mol:	-138.58
Dipole, Da:	5.12
IP(EA), eV:	-9.26(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-2-(2-nitroanilino)acetamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1CCCN(C1)C(=O)C2CC3CCCCC3N2C(=O)C4=CC=CC=C4

DOS

IR

Vibrations