Geometry & MOs

Info

ID:	278488
PubChem CID:	103836264
Reduced:	NSO3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-131.7
Dipole, Da:	6.71
IP(EA), eV:	-9.88(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-diethyl-3-(1-hydroxy-4-methylpentan-3-yl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)NC(CCO)C(C)C

DOS

IR

Vibrations