Geometry & MOs

Info

ID:	396126
PubChem CID:	135027499
Reduced:	NOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	434.220682
ΔH_f, kcal/mol:	14.38
Dipole, Da:	6.75
IP(EA), eV:	-8.76(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3R,4S)-4-methyl-6-tributylstannylhept-5-ene-3,4-diol

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations