Geometry & MOs

Info

ID:	59378
PubChem CID:	24844238
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-104.56
Dipole, Da:	5.57
IP(EA), eV:	-8.8(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-propan-2-ylcarbamate

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C(C)C)C(=O)OC3CCCCC3

DOS

IR

Vibrations