Geometry & MOs

Info

ID:	392132
PubChem CID:	135013196
Reduced:	NSO3C19H23 (1)
Stoich.:	ABC3D19E23 (1)
Weight, g/mol:	596.336256
ΔH_f, kcal/mol:	-96.32
Dipole, Da:	4.28
IP(EA), eV:	-9.4(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5,10,10,15,20,20-hexamethyl-15-(2-prop-2-enoyloxyethyl)-21,22,23,24-tetrahydroporphyrin-5-yl]ethyl prop-2-enoate

Drug info:

PubChemData

Smile

CC1C2CC3CN(CC3(C1=O)C=C2C)S(=O)(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations