Geometry & MOs

Info

ID:	128723
PubChem CID:	51055653
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	141.090212
ΔH_f, kcal/mol:	-12.32
Dipole, Da:	3.56
IP(EA), eV:	-8.3(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-3-methylbut-3-en-2-ylideneamino]urea

Drug info:

PubChemData

Smile

CC\1CN(C(=O)/C1=N\NC2=CC=CC=C2)C3CCCCC3

DOS

IR

Vibrations