Geometry & MOs

Info

ID:	342819
PubChem CID:	127265982
Reduced:	N3O5C13H19 (1)
Stoich.:	A3B5C13D19 (1)
Weight, g/mol:	289.215413
ΔH_f, kcal/mol:	-134.74
Dipole, Da:	5.74
IP(EA), eV:	-9.4(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-3,3,5,5-tetramethylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NCC(C)(CO)CO

DOS

IR

Vibrations