Geometry & MOs

Info

ID:	354375
PubChem CID:	127286619
Reduced:	O2N5C20H37 (1)
Stoich.:	A2B5C20D37 (1)
Weight, g/mol:	282.169191
ΔH_f, kcal/mol:	-115.91
Dipole, Da:	2.76
IP(EA), eV:	-8.56(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-oxo-N-(2-oxo-2-piperidin-1-ylethyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1CCN2CCN(CC2)C(=O)NCC(=O)N3CCCCC3)C

DOS

IR

Vibrations