Geometry & MOs

Info

ID:	282492
PubChem CID:	103928834
Reduced:	OSN2C14H24 (1)
Stoich.:	ABC2D14E24 (1)
Weight, g/mol:	254.174276
ΔH_f, kcal/mol:	-57.84
Dipole, Da:	3.55
IP(EA), eV:	-9.17(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-3,3-dimethylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=CS1)NC(=O)[C@@H](C(C)(C)C)N

DOS

IR

Vibrations