Geometry & MOs

Info

ID:	408202
PubChem CID:	135080963
Reduced:	BN6H17C26 (1)
Stoich.:	AB6C17D26 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	150.63
Dipole, Da:	3.55
IP(EA), eV:	-7.61(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-N-benzyl-2-hydroxybutanamide

Drug info:

PubChemData

Smile

[B-]12(N3C4=C5C=CC=CC5=C3N=C6[N+]1=C(C7=CC=CC=C76)N=C8N2C(=N4)C9=CC=CC=C98)CC

DOS

IR

Vibrations