Geometry & MOs

Info

ID:	74157
PubChem CID:	48421528
Reduced:	N3O6C16H25 (1)
Stoich.:	A3B6C16D25 (1)
Weight, g/mol:	358.165935
ΔH_f, kcal/mol:	-180.32
Dipole, Da:	3.52
IP(EA), eV:	-9.47(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-methylphenyl)-1-[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]-1-methylurea

Drug info:

PubChemData

Smile

CC(C)OCCOCC(CN(C)C(=O)NC1=CC=CC=C1[N+](=O)[O-])O

DOS

IR

Vibrations