Geometry & MOs

Info

ID:	132114
PubChem CID:	51310128
Reduced:	O2N4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	333.132471
ΔH_f, kcal/mol:	-3.61
Dipole, Da:	4.84
IP(EA), eV:	-9.22(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(1,5-dimethylpyrazole-4-carbonyl)amino]-4,5-dimethoxybenzoate

Drug info:

PubChemData

Smile

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC(C)COC

DOS

IR

Vibrations