Geometry & MOs

Info

ID:	310516
PubChem CID:	126581492
Reduced:	FON5C19H22 (1)
Stoich.:	ABC5D19E22 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	0.39
Dipole, Da:	7.95
IP(EA), eV:	-8.56(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopropylmethyl)-3-methyl-3-propan-2-ylpyrrolidine

Drug info:

PubChemData

Smile

C1CC1CN2CC3CC3(C2)/C(=C/N)/C4=NC5=C(C=C(C=C5N4)F)C(=O)N

DOS

IR

Vibrations