Geometry & MOs

Info

ID:	222501
PubChem CID:	85300931
Reduced:	NSO2C20H27 (1)
Stoich.:	ABC2D20E27 (1)
Weight, g/mol:	225.164326
ΔH_f, kcal/mol:	-86.92
Dipole, Da:	2.05
IP(EA), eV:	-9.18(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCCCCC1C=C(CC2C1C(=O)N(C2=O)C)C3=CC=CS3

DOS

IR

Vibrations