Geometry & MOs

Info

ID:	413097
PubChem CID:	135086041
Reduced:	SN2O4C15H20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	324.114378
ΔH_f, kcal/mol:	-99.1
Dipole, Da:	4.7
IP(EA), eV:	-8.98(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl N-(propan-2-yloxycarbonylamino)-N-(3-thiophen-3-ylprop-2-ynyl)carbamate

Drug info:

PubChemData

Smile

CC(C)OC(=O)NN(CC#CC1=CC=CS1)C(=O)OC(C)C

DOS

IR

Vibrations