Geometry & MOs

Info

ID:	195581
PubChem CID:	78704289
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-85.99
Dipole, Da:	2.81
IP(EA), eV:	-8.17(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 4-(dimethylamino)benzoate

Drug info:

PubChemData

Smile

CC(C(=O)N)NC1=C(C=CC(=C1)C(C)(C)C)OC

DOS

IR

Vibrations