Geometry & MOs

Info

ID:	36565
PubChem CID:	8008978
Reduced:	N3O5C19H29 (1)
Stoich.:	A3B5C19D29 (1)
Weight, g/mol:	378.202896
ΔH_f, kcal/mol:	-263.48
Dipole, Da:	5.9
IP(EA), eV:	-10.0(0.17)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2R)-2-[[(2R)-2-(adamantane-2-carbonylamino)propanoyl]amino]-5-amino-5-oxopentanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@H](CCC(=O)N)C(=O)O)NC(=O)C1C2CC3CC(C2)CC1C3

DOS

IR

Vibrations