Geometry & MOs

Info

ID:	357664
PubChem CID:	127294338
Reduced:	ON2C10H16 (2)
Stoich.:	AB2C10D16 (2)
Weight, g/mol:	388.258674
ΔH_f, kcal/mol:	-52.18
Dipole, Da:	5.66
IP(EA), eV:	-8.77(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butyl-5-methylpyrazol-3-yl)-2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)CC(=O)N(C3CCCC3)C4CC4)C

DOS

IR

Vibrations