Geometry & MOs

Info

ID:	408010
PubChem CID:	135080765
Reduced:	NOC13H21 (1)
Stoich.:	ABC13D21 (1)
Weight, g/mol:	192.9642
ΔH_f, kcal/mol:	-53.18
Dipole, Da:	4.76
IP(EA), eV:	-8.0(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[C@@H]1C=CN(C(=C1C(=O)C)C)C(C)C

DOS

IR

Vibrations