Geometry & MOs

Info

ID:	163522
PubChem CID:	58023914
Reduced:	ON4C23H28 (1)
Stoich.:	AB4C23D28 (1)
Weight, g/mol:	385.143129
ΔH_f, kcal/mol:	27.46
Dipole, Da:	6.47
IP(EA), eV:	-6.79(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-3-[(3-hydroxypyrrolidin-1-yl)methyl]-2H-imidazo[1,5-a]pyridin-4-ium-1-carboxamide

Drug info:

PubChemData

Smile

C[C@@]12CCC(C1(C)C)C[C@@H]2NC(=O)C3=[N+]4C=CC=CC4=C(N3)C5=CC=[NH+]C=C5

DOS

IR

Vibrations