Geometry & MOs

Info

ID:	437304
PubChem CID:	135222365
Reduced:	BrO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	374.141262
ΔH_f, kcal/mol:	-80.65
Dipole, Da:	2.31
IP(EA), eV:	-9.16(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(cyclobutylmethylsulfamoyl)phenyl]-3-(pyridin-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)COCCCCC(=O)CBr

DOS

IR

Vibrations