Geometry & MOs

Info

ID:	327976
PubChem CID:	126691595
Reduced:	ClOSC4N5H6 (1)
Stoich.:	ABCD4E5F6 (1)
Weight, g/mol:	260.132491
ΔH_f, kcal/mol:	52.6
Dipole, Da:	2.22
IP(EA), eV:	-9.73(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-fluorocyclohexa-1,5-dien-1-yl)-1-(methylamino)-6,7-dihydro-5H-pyrrolizine-2-carbaldehyde

Drug info:

PubChemData

Smile

C(/N=C(/C(=N)C(=O)Cl)\N)(N=N)S

DOS

IR

Vibrations