Geometry & MOs

Info

ID:	147878
PubChem CID:	53787536
Reduced:	ClSSiN2O4C23H35 (1)
Stoich.:	ABCD2E4F23G35 (1)
Weight, g/mol:	588.55938
ΔH_f, kcal/mol:	-251.88
Dipole, Da:	3.55
IP(EA), eV:	-9.31(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,36-diisocyanatohexatriacontane

Drug info:

PubChemData

Smile

CC(CC1=NC=C(S1)CCC(=O)O)NC[C@@H](C2=CC(=CC=C2)Cl)O[Si](C)(C)OC(C)(C)C

DOS

IR

Vibrations