Geometry & MOs

Info

ID:	383811
PubChem CID:	134975749
Reduced:	P2N4C11H28 (1)
Stoich.:	A2B4C11D28 (1)
Weight, g/mol:	182.112922
ΔH_f, kcal/mol:	-21.87
Dipole, Da:	1.37
IP(EA), eV:	-7.0(1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophene

Drug info:

PubChemData

Smile

CC1=P(C=P1(N(C)C)N(C)C)(N(C)C)N(C)C

DOS

IR

Vibrations