Geometry & MOs

Info

ID:	423721
PubChem CID:	135120072
Reduced:	FON2C8H9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	300.183778
ΔH_f, kcal/mol:	-122.25
Dipole, Da:	2.83
IP(EA), eV:	-10.06(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-cyclopropylpyrrol-2-yl)-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-en-9-yl)methanone

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C(F)F)C(=O)N[C@@H]2COC[C@H]2CC3=CC=NC=C3

DOS

IR

Vibrations