Geometry & MOs

Info

ID:	218641
PubChem CID:	85089741
Reduced:	ClN4O6C23H25 (1)
Stoich.:	AB4C6D23E25 (1)
Weight, g/mol:	490.283283
ΔH_f, kcal/mol:	-108.37
Dipole, Da:	7.95
IP(EA), eV:	-9.32(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4,4-dimethyl-3-tributylstannylpent-1-enoxy)pentan-2-ol

Drug info:

PubChemData

Smile

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(CC3=NC=CN3)C4=CC(=CC=C4)Cl)O)C(OC)OC

DOS

IR

Vibrations