Geometry & MOs

Info

ID:	311377
PubChem CID:	126591248
Reduced:	N3O4C9H17 (1)
Stoich.:	A3B4C9D17 (1)
Weight, g/mol:	285.03644
ΔH_f, kcal/mol:	32.0
Dipole, Da:	2.78
IP(EA), eV:	-9.25(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-3-(4-bromophenyl)pentanoate

Drug info:

PubChemData

Smile

CCCN1C[C@@H]1C=C(COONOC)N=O

DOS

IR

Vibrations