Geometry & MOs

Info

ID:	150957
PubChem CID:	53790654
Reduced:	NO3C21H43 (1)
Stoich.:	AB3C21D43 (1)
Weight, g/mol:	239.08254
ΔH_f, kcal/mol:	-206.28
Dipole, Da:	2.88
IP(EA), eV:	-9.86(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-aminobutylidene)-3-(4-chlorophenyl)urea

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(C(C)OC(=O)N(C)C)O

DOS

IR

Vibrations