Geometry & MOs

Info

ID:	311005
PubChem CID:	126588785
Reduced:	BrNOSC19H22 (1)
Stoich.:	ABCDE19F22 (1)
Weight, g/mol:	362.13972
ΔH_f, kcal/mol:	-1.32
Dipole, Da:	4.38
IP(EA), eV:	-8.29(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-2-[(4-ethyl-2,5-dimethylphenoxy)methyl]phenyl]-1-hydroxy-3-methylurea

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2Br)NC(=S)CC)C

DOS

IR

Vibrations