Geometry & MOs

Info

ID:	350697
PubChem CID:	127278985
Reduced:	SN4O4C16H26 (1)
Stoich.:	AB4C4D16E26 (1)
Weight, g/mol:	272.173607
ΔH_f, kcal/mol:	-139.35
Dipole, Da:	5.11
IP(EA), eV:	-8.91(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1,4-dioxane-2-carboxamide

Drug info:

PubChemData

Smile

CC1(COCCN1CCNC(=O)CN(C)S(=O)(=O)C2=CN=CC=C2)C

DOS

IR

Vibrations