Geometry & MOs

Info

ID:	75066
PubChem CID:	48422939
Reduced:	SN2O5C16H22 (1)
Stoich.:	AB2C5D16E22 (1)
Weight, g/mol:	275.119129
ΔH_f, kcal/mol:	-212.92
Dipole, Da:	3.88
IP(EA), eV:	-9.73(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[(1,1-dioxothiolan-3-yl)methyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2CCS(=O)(=O)C2

DOS

IR

Vibrations