Geometry & MOs

Info

ID:	270778
PubChem CID:	103638078
Reduced:	ON3C14H27 (1)
Stoich.:	AB3C14D27 (1)
Weight, g/mol:	227.199762
ΔH_f, kcal/mol:	-55.98
Dipole, Da:	3.4
IP(EA), eV:	-8.74(1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-3-[2-[cyclopropyl(ethyl)amino]ethyl]urea

Drug info:

PubChemData

Smile

CCN(CCNC(=O)NC1CCCCC1)C2CC2

DOS

IR

Vibrations