Geometry & MOs

Info

ID:	197892
PubChem CID:	79011963
Reduced:	N2O3C11H22 (1)
Stoich.:	A2B3C11D22 (1)
Weight, g/mol:	220.157563
ΔH_f, kcal/mol:	-169.81
Dipole, Da:	4.79
IP(EA), eV:	-9.77(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3-methyl-N-[(3-methylphenyl)methyl]butanamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)NCC(C(C)C)C(=O)O)N

DOS

IR

Vibrations