Geometry & MOs

Info

ID:	130920
PubChem CID:	51128946
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	420.179755
ΔH_f, kcal/mol:	-68.41
Dipole, Da:	7.52
IP(EA), eV:	-8.75(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-hydroxyphenyl)methyl]-3-[3-[(2-hydroxyphenyl)methylcarbamoylamino]-4-methylphenyl]urea

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1CCN(CC1)CC2=CC(=O)N3C=C(C=CC3=N2)C

DOS

IR

Vibrations