Geometry & MOs

Info

ID:	340009
PubChem CID:	127262018
Reduced:	N5O6C24H43 (1)
Stoich.:	A5B6C24D43 (1)
Weight, g/mol:	476.29987
ΔH_f, kcal/mol:	-320.14
Dipole, Da:	8.28
IP(EA), eV:	-9.59(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-acetamido-N-[2-[(2-amino-2-oxoethyl)-hexylamino]-2-oxoethyl]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCCC1)N(CC(=O)N)C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C

DOS

IR

Vibrations