Geometry & MOs

Info

ID:	160406
PubChem CID:	57309754
Reduced:	O3C25H30 (1)
Stoich.:	A3B25C30 (1)
Weight, g/mol:	198.111676
ΔH_f, kcal/mol:	-117.61
Dipole, Da:	0.87
IP(EA), eV:	-9.49(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-oxoimidazolidin-1-yl)-1,3-diazepan-2-one

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=CC=CC=C2)OC(=O)OC3(CCCCC3)C4=CC=CC=C4

DOS

IR

Vibrations