Geometry & MOs

Info

ID:	81826
PubChem CID:	49855217
Reduced:	ON3H6C8 (2)
Stoich.:	AB3C6D8 (2)
Weight, g/mol:	303.133139
ΔH_f, kcal/mol:	90.69
Dipole, Da:	7.95
IP(EA), eV:	-9.34(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,5-dimethylpyrazole-3-carbonyl)amino]-3-(2-methoxyphenyl)urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)COC4=NC=CC=N4

DOS

IR

Vibrations