Geometry & MOs

Info

ID:	339660
PubChem CID:	127261662
Reduced:	N3O3C11H15 (1)
Stoich.:	A3B3C11D15 (1)
Weight, g/mol:	296.163711
ΔH_f, kcal/mol:	-70.35
Dipole, Da:	3.8
IP(EA), eV:	-8.2(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[(4-butylphenyl)-pyridin-3-ylmethylidene]amino]urea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1/C=N/NC(=O)N)OC)OC

DOS

IR

Vibrations