Geometry & MOs

Info

ID:	30633
PubChem CID:	841597
Reduced:	FON4C13H13 (1)
Stoich.:	ABC4D13E13 (1)
Weight, g/mol:	343.083602
ΔH_f, kcal/mol:	2.12
Dipole, Da:	2.82
IP(EA), eV:	-8.74(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chloro-2-methylpyrazole-3-carbonyl)amino]-3-naphthalen-1-ylurea

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C=NNC(=O)C2=CC(=CC=C2)F

DOS

IR

Vibrations