Geometry & MOs

Info

ID:	57002
PubChem CID:	22395205
Reduced:	HN2O2C3F3 (1)
Stoich.:	AB2C2D3E3 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-190.5
Dipole, Da:	3.28
IP(EA), eV:	-11.21(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-aminocyclohexyl)methyl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

C(=C(/O)\[O-])(\C(F)(F)F)/[N+]#N

DOS

IR

Vibrations