Geometry & MOs

Info

ID:	425600
PubChem CID:	135126911
Reduced:	NOC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	226.110613
ΔH_f, kcal/mol:	-68.6
Dipole, Da:	2.52
IP(EA), eV:	-9.28(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC(=O)CCNCC1=CC=C(C=C1)CN

DOS

IR

Vibrations