Geometry & MOs

Info

ID:	363469
PubChem CID:	127311272
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	372.107854
ΔH_f, kcal/mol:	-50.07
Dipole, Da:	8.47
IP(EA), eV:	-9.08(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)C3CCC(=O)N(C3C4=CC=CC=C4)C

DOS

IR

Vibrations