Geometry & MOs

Info

ID:	349990
PubChem CID:	127276863
Reduced:	SN3O3C20H31 (1)
Stoich.:	AB3C3D20E31 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-118.88
Dipole, Da:	4.72
IP(EA), eV:	-8.69(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-5-methyl-3-[2-oxo-2-(4-propan-2-yl-1,4-diazepan-1-yl)ethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)N1CCCN(CC1)C(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations