Geometry & MOs

Info

ID:	12129
PubChem CID:	131103
Reduced:	N2O3C19H38 (1)
Stoich.:	A2B3C19D38 (1)
Weight, g/mol:	342.288243
ΔH_f, kcal/mol:	-184.58
Dipole, Da:	5.61
IP(EA), eV:	-9.04(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[butyl(ethyl)amino]-4-(dibutylamino)-1,3-dioxepan-2-one

Drug info:

PubChemData

Smile

CCCCN(CC)C1(CCCOC(=O)O1)N(CCCC)CCCC

DOS

IR

Vibrations