Geometry & MOs

Info

ID:	205547
PubChem CID:	80119485
Reduced:	N3O4C14H27 (1)
Stoich.:	A3B4C14D27 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-219.38
Dipole, Da:	8.44
IP(EA), eV:	-10.1(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-methyl-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]benzoic acid

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NCC(CC(C)C)C(=O)O)NC(=O)N

DOS

IR

Vibrations