Geometry & MOs

Info

ID:	244604
PubChem CID:	99368186
Reduced:	O3N4C21H26 (1)
Stoich.:	A3B4C21D26 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-96.3
Dipole, Da:	5.0
IP(EA), eV:	-9.17(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2-methyl-5-propan-2-ylphenoxy)-N-[2-[methyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@H](CC(=O)NCC(=O)N(C)CC2=CN=CC=C2)NC(=O)C

DOS

IR

Vibrations