Geometry & MOs

Info

ID:	72657
PubChem CID:	48416406
Reduced:	SO2N5C18H27 (1)
Stoich.:	AB2C5D18E27 (1)
Weight, g/mol:	388.211055
ΔH_f, kcal/mol:	-77.12
Dipole, Da:	7.32
IP(EA), eV:	-8.56(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations