Geometry & MOs

Info

ID:	227968
PubChem CID:	87563140
Reduced:	NC13H17 (1)
Stoich.:	AB13C17 (1)
Weight, g/mol:	103.033968
ΔH_f, kcal/mol:	15.8
Dipole, Da:	2.89
IP(EA), eV:	-7.93(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CCC(=C1C)C2=C(NC(=C2)C)C

DOS

IR

Vibrations