Geometry & MOs

Info

ID:	217239
PubChem CID:	85087484
Reduced:	NOSiC21H35 (1)
Stoich.:	ABCD21E35 (1)
Weight, g/mol:	345.088019
ΔH_f, kcal/mol:	-71.23
Dipole, Da:	1.36
IP(EA), eV:	-8.38(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2,2-dimethyl-4-(1-methyl-6-oxopyridazin-3-yl)oxy-3,4-dihydrochromene-6-carbonitrile

Drug info:

PubChemData

Smile

C1CCCN(CC1)CC[Si](CO)(C2CCCCC2)C3=CC=CC=C3

DOS

IR

Vibrations