Geometry & MOs

Info

ID:	199588
PubChem CID:	79268537
Reduced:	NO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	251.152144
ΔH_f, kcal/mol:	-156.58
Dipole, Da:	3.42
IP(EA), eV:	-9.18(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methoxyphenyl)methyl 2-(tert-butylamino)acetate

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=O)OCCCOC

DOS

IR

Vibrations