Geometry & MOs

Info

ID:	136129
PubChem CID:	51984813
Reduced:	O2N5C13H15 (1)
Stoich.:	A2B5C13D15 (1)
Weight, g/mol:	307.146681
ΔH_f, kcal/mol:	35.28
Dipole, Da:	3.0
IP(EA), eV:	-8.43(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(thian-4-yl)propanamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1N(N=C2)CC(=O)NCC3=CC=CO3)C

DOS

IR

Vibrations