Geometry & MOs

Info

ID:	187785
PubChem CID:	77622460
Reduced:	SiO3C33H44 (1)
Stoich.:	AB3C33D44 (1)
Weight, g/mol:	199.095691
ΔH_f, kcal/mol:	-129.7
Dipole, Da:	2.86
IP(EA), eV:	-8.79(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-5-oxo-1,4-dihydropyrazol-3-yl)ethyl carbamate

Drug info:

PubChemData

Smile

CC(C=CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(CCO)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations