Geometry & MOs

Info

ID:	339683
PubChem CID:	127261685
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	267.137162
ΔH_f, kcal/mol:	-42.75
Dipole, Da:	4.31
IP(EA), eV:	-8.44(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-benzylideneamino]-3-(2,5-dimethylphenyl)urea

Drug info:

PubChemData

Smile

CCCCC/C(=N/NC(=O)NC1=C(C=CC(=C1)C)C)/C

DOS

IR

Vibrations