Geometry & MOs

Info

ID:	270685
PubChem CID:	103637688
Reduced:	ON2C12H26 (1)
Stoich.:	AB2C12D26 (1)
Weight, g/mol:	290.00885
ΔH_f, kcal/mol:	-90.43
Dipole, Da:	4.29
IP(EA), eV:	-9.14(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(5-bromothiophen-2-yl)ethyl]-1-ethyl-1-methylurea

Drug info:

PubChemData

Smile

CCCCC(CC)CNC(=O)N(C)CC

DOS

IR

Vibrations