Geometry & MOs

Info

ID:	5090
PubChem CID:	12572
Reduced:	O3N4C10H16 (1)
Stoich.:	A3B4C10D16 (1)
Weight, g/mol:	240.12224
ΔH_f, kcal/mol:	-80.51
Dipole, Da:	4.43
IP(EA), eV:	-9.29(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(dimethylcarbamoyl)-5-methylpyrazol-3-yl] N,N-dimethylcarbamate

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(=O)N(C)C)OC(=O)N(C)C

DOS

IR

Vibrations