Geometry & MOs

Info

ID:	402476
PubChem CID:	135056136
Reduced:	NSO3C18H23 (1)
Stoich.:	ABC3D18E23 (1)
Weight, g/mol:	288.168522
ΔH_f, kcal/mol:	-103.22
Dipole, Da:	3.47
IP(EA), eV:	-9.02(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl N-[(2R)-3-oxopentan-2-yl]-N-(propan-2-yloxycarbonylamino)carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C([C@@H]4CC[C@@]3(C2)COC4)C

DOS

IR

Vibrations