Geometry & MOs

Info

ID:	349316
PubChem CID:	127275103
Reduced:	N2O4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	346.192629
ΔH_f, kcal/mol:	-168.75
Dipole, Da:	1.21
IP(EA), eV:	-8.24(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothiolan-3-yl)-2-(2-methyl-1,4-oxazepan-4-yl)-N-propylpropanamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(C)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

DOS

IR

Vibrations