Geometry & MOs

Info

ID:	369512
PubChem CID:	127334268
Reduced:	O2N5C18H21 (1)
Stoich.:	A2B5C18D21 (1)
Weight, g/mol:	343.200825
ΔH_f, kcal/mol:	5.22
Dipole, Da:	3.18
IP(EA), eV:	-9.52(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-(1H-indazol-5-ylamino)-3-methyl-1-oxopentan-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CCC(CC2)NC(=O)C3=NC=CC(=C3)N4C=CC=N4

DOS

IR

Vibrations