Geometry & MOs

Info

ID:	82098
PubChem CID:	49855598
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-98.82
Dipole, Da:	4.49
IP(EA), eV:	-8.42(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-4-[4-(6-propan-2-yloxypyridin-3-yl)oxyphenyl]butan-2-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](CCC1=CC=C(C=C1)OC2=NC=C(C=C2)OC(C)C)NC(=O)C

DOS

IR

Vibrations