Geometry & MOs

Info

ID:	340010
PubChem CID:	127262019
Reduced:	N4O5C25H40 (1)
Stoich.:	A4B5C25D40 (1)
Weight, g/mol:	357.201219
ΔH_f, kcal/mol:	-247.26
Dipole, Da:	12.71
IP(EA), eV:	-8.24(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(2-acetamidoacetyl)amino]-N-[2-[(2-amino-2-oxoethyl)-methylamino]-2-oxoethyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CCCCCCN(CC(=O)N)C(=O)CNC(=O)[C@H](CC1=CC=C(C=C1)OC(C)(C)C)NC(=O)C

DOS

IR

Vibrations