Geometry & MOs

Info

ID:	183819
PubChem CID:	77074054
Reduced:	NO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	242.199428
ΔH_f, kcal/mol:	-139.54
Dipole, Da:	4.93
IP(EA), eV:	-9.19(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-(dimethylamino)ethyl-propylamino]-2-methylbut-2-enoate

Drug info:

PubChemData

Smile

CC1CN(CC(O1)(C)C)CC=C(C)C(=O)O

DOS

IR

Vibrations