Geometry & MOs

Info

ID:	233273
PubChem CID:	89449604
Reduced:	NOC16H21 (1)
Stoich.:	ABC16D21 (1)
Weight, g/mol:	492.050056
ΔH_f, kcal/mol:	-38.64
Dipole, Da:	5.22
IP(EA), eV:	-8.24(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=C1C)C(=C(C(=O)N2C)C)C)C)C

DOS

IR

Vibrations