Geometry & MOs

Info

ID:	204532
PubChem CID:	79977844
Reduced:	SN2O2C16H16 (1)
Stoich.:	AB2C2D16E16 (1)
Weight, g/mol:	265.11365
ΔH_f, kcal/mol:	2.34
Dipole, Da:	3.43
IP(EA), eV:	-8.99(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclopropylphenyl)-(1,1-dioxothiolan-3-yl)methanamine

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)C(=O)NC2=C(N=CC=C2)C)C#CCCO

DOS

IR

Vibrations