Geometry & MOs

Info

ID:	30435
PubChem CID:	841334
Reduced:	FO3N4H11C12 (1)
Stoich.:	AB3C4D11E12 (1)
Weight, g/mol:	254.141913
ΔH_f, kcal/mol:	-37.13
Dipole, Da:	4.1
IP(EA), eV:	-9.24(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethylphenyl)-3-(3-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)F)C

DOS

IR

Vibrations