Geometry & MOs

Info

ID:	63877
PubChem CID:	26759397
Reduced:	BrNO5C19H20 (1)
Stoich.:	ABC5D19E20 (1)
Weight, g/mol:	373.152537
ΔH_f, kcal/mol:	-164.22
Dipole, Da:	7.56
IP(EA), eV:	-8.63(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(4-methoxyanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC(=CC=C1)Br)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations