Geometry & MOs

Info

ID:	226721
PubChem CID:	87557833
Reduced:	OSN4C14H20 (1)
Stoich.:	ABC4D14E20 (1)
Weight, g/mol:	310.095357
ΔH_f, kcal/mol:	-25.16
Dipole, Da:	2.12
IP(EA), eV:	-8.68(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-diisocyanato-1-phenoxypropan-2-yl)oxybenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)N2CCN(CC2)C(=S)N

DOS

IR

Vibrations