Geometry & MOs

Info

ID:	339944
PubChem CID:	127261953
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	319.13795
ΔH_f, kcal/mol:	-50.9
Dipole, Da:	5.39
IP(EA), eV:	-9.02(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2,9-diamino-5-[(R)-amino(carboxy)methyl]-6-oxodecanedioic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N([C@@H](CCCCN)C(=O)N)C(=O)CN(C)CC2=CC=CC=C2

DOS

IR

Vibrations