Geometry & MOs

Info

ID:	75627
PubChem CID:	48423759
Reduced:	SO2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	257.141579
ΔH_f, kcal/mol:	-11.38
Dipole, Da:	3.06
IP(EA), eV:	-8.65(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-(3-phenylprop-2-ynyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(CCSC)C1=NN=C2N1C=CC=C2)OCC3CC3

DOS

IR

Vibrations