Geometry & MOs

Info

ID:	339681
PubChem CID:	127261683
Reduced:	O2N3C8H13 (1)
Stoich.:	A2B3C8D13 (1)
Weight, g/mol:	195.137162
ΔH_f, kcal/mol:	-49.12
Dipole, Da:	4.3
IP(EA), eV:	-9.19(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-2-bicyclo[4.2.1]nonanylideneamino]urea

Drug info:

PubChemData

Smile

C1CC(OC1)/C=C/C=N/NC(=O)N

DOS

IR

Vibrations