Geometry & MOs

Info

ID:	390144
PubChem CID:	134997309
Reduced:	BNSiSnC22H49 (1)
Stoich.:	ABCDE22F49 (1)
Weight, g/mol:	238.11892
ΔH_f, kcal/mol:	-25.1
Dipole, Da:	2.82
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.755082
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-methyl-2-[(1S,2R)-2-trimethylsilylcyclopropyl]phenol

Drug info:

PubChemData

Smile

[B-][N@@+]1(C[C@@H]1[Sn](CCCC)(CCCC)CCCC)CC[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations