Geometry & MOs

Info

ID:	197967
PubChem CID:	79023204
Reduced:	ON2C11H24 (1)
Stoich.:	AB2C11D24 (1)
Weight, g/mol:	206.141913
ΔH_f, kcal/mol:	-91.72
Dipole, Da:	2.72
IP(EA), eV:	-9.53(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(1R)-1-phenylethyl]butanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations