Geometry & MOs

Info

ID:	149192
PubChem CID:	53788864
Reduced:	NPS2O3C6H14 (1)
Stoich.:	ABC2D3E6F14 (1)
Weight, g/mol:	289.131408
ΔH_f, kcal/mol:	-186.15
Dipole, Da:	3.98
IP(EA), eV:	-9.28(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-1-phenylmethoxycarbonylpyrrolidin-3-yl]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCCOP(=S)(ON=C(C)OC)S

DOS

IR

Vibrations