Geometry & MOs

Info

ID:	362506
PubChem CID:	127308045
Reduced:	F2N3O4C19H23 (1)
Stoich.:	A2B3C4D19E23 (1)
Weight, g/mol:	304.201159
ΔH_f, kcal/mol:	-252.33
Dipole, Da:	13.95
IP(EA), eV:	-8.49(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2CCCN(C2)CC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

DOS

IR

Vibrations