Geometry & MOs

Info

ID:	282489
PubChem CID:	103928804
Reduced:	N3O4C13H19 (1)
Stoich.:	A3B4C13D19 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-88.72
Dipole, Da:	2.22
IP(EA), eV:	-9.02(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-nitrophenyl)butanamide

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])N

DOS

IR

Vibrations