Geometry & MOs

Info

ID:	281428
PubChem CID:	103913862
Reduced:	O2N4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	306.161329
ΔH_f, kcal/mol:	-91.65
Dipole, Da:	2.6
IP(EA), eV:	-9.07(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(1,1-dioxothian-3-yl)amino]ethyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations