Geometry & MOs

Info

ID:	404906
PubChem CID:	135071697
Reduced:	NSSiO3C26H33 (1)
Stoich.:	ABCD3E26F33 (1)
Weight, g/mol:	346.19328
ΔH_f, kcal/mol:	-55.01
Dipole, Da:	5.66
IP(EA), eV:	-8.72(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,2S)-2-phenyl-1-(3-phenylmethoxyprop-1-ynyl)cyclopropyl]pentan-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CC#CCO[Si](C)(C)C(C)(C)C)CC#CC2=CC=CC=C2

DOS

IR

Vibrations