Geometry & MOs

Info

ID:	74057
PubChem CID:	48421404
Reduced:	Cl2N2O3C18H20 (1)
Stoich.:	A2B2C3D18E20 (1)
Weight, g/mol:	359.148121
ΔH_f, kcal/mol:	-103.59
Dipole, Da:	3.82
IP(EA), eV:	-8.98(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-3-phenylmethoxypropyl)-1-methyl-3-(2-nitrophenyl)urea

Drug info:

PubChemData

Smile

CN(CC(COCC1=CC=CC=C1)O)C(=O)NC2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations