Geometry & MOs

Info

ID:	344420
PubChem CID:	127267596
Reduced:	N2O4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	350.147786
ΔH_f, kcal/mol:	-157.79
Dipole, Da:	6.27
IP(EA), eV:	-9.21(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(1,4-dioxane-2-carbonylamino)phenyl]methyl]-1,4-dioxane-2-carboxamide

Drug info:

PubChemData

Smile

C1COCC1C(=O)NCC2=CC(=CC=C2)NC(=O)C3CCOC3

DOS

IR

Vibrations