Geometry & MOs

Info

ID:	190849
PubChem CID:	78068334
Reduced:	N6O7C24H36 (1)
Stoich.:	A6B7C24D36 (1)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-323.2
Dipole, Da:	10.68
IP(EA), eV:	-9.62(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-3-phenylpropanoyl)-methylamino]-3-phenylmethoxypropanoic acid

Drug info:

PubChemData

Smile

CC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C(C)N

DOS

IR

Vibrations