Geometry & MOs

Info

ID:	18440
PubChem CID:	540977
Reduced:	NO2C16H24 (2)
Stoich.:	AB2C16D24 (2)
Weight, g/mol:	524.361408
ΔH_f, kcal/mol:	-176.53
Dipole, Da:	2.4
IP(EA), eV:	-8.8(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-hexadecanoyl-3-morpholin-4-yl-4-phenylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)N1C=C(C(=C1C(=O)OC)N2CCOCC2)C3=CC=CC=C3

DOS

IR

Vibrations