Geometry & MOs

Info

ID:	412044
PubChem CID:	135084907
Reduced:	N3C5H8 (2)
Stoich.:	A3B5C8 (2)
Weight, g/mol:	242.134051
ΔH_f, kcal/mol:	68.15
Dipole, Da:	1.0
IP(EA), eV:	-7.99(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-butylsulfanylbut-3-ynoxy)oxane

Drug info:

PubChemData

Smile

CN1C=NC2=C1N=C(N=C2N(C)C)N(C)C

DOS

IR

Vibrations