Geometry & MOs

Info

ID:	360323
PubChem CID:	127300966
Reduced:	O2N4C21H34 (1)
Stoich.:	A2B4C21D34 (1)
Weight, g/mol:	380.167083
ΔH_f, kcal/mol:	-106.35
Dipole, Da:	2.13
IP(EA), eV:	-8.96(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-6-thiophen-3-ylpyridin-3-yl)-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)C(C)NC(=O)CC3CCCCC3

DOS

IR

Vibrations