Geometry & MOs

Info

ID:	447734
PubChem CID:	135285207
Reduced:	N2O3C12H20 (2)
Stoich.:	A2B3C12D20 (2)
Weight, g/mol:	554.465873
ΔH_f, kcal/mol:	-289.98
Dipole, Da:	6.35
IP(EA), eV:	-9.58(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 18-[[6-amino-1-[(2-methylpropan-2-yl)oxy]-1-oxohexan-2-yl]amino]-18-oxooctadecanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CCCCN(CCCNC(=O)OCC1=CC=CC=C1)C(=O)O)CCCN

DOS

IR

Vibrations