Geometry & MOs

Info

ID:	63918
PubChem CID:	26759475
Reduced:	N2O6C21H24 (1)
Stoich.:	A2B6C21D24 (1)
Weight, g/mol:	366.179087
ΔH_f, kcal/mol:	-213.82
Dipole, Da:	2.16
IP(EA), eV:	-8.52(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NCC1=CC=CC=C1)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations