Geometry & MOs

Info

ID:	224742
PubChem CID:	85349158
Reduced:	N2O5C10H14 (1)
Stoich.:	A2B5C10D14 (1)
Weight, g/mol:	242.116293
ΔH_f, kcal/mol:	-203.76
Dipole, Da:	2.25
IP(EA), eV:	-10.2(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylbuta-1,3-dienyl)-2-(2-methylpropyl)-1,3-dithiane

Drug info:

PubChemData

Smile

C1=CC(=O)NC(=O)C1C2C(C(C(O2)CO)O)N

DOS

IR

Vibrations