Geometry & MOs

Info

ID:	188739
PubChem CID:	77760634
Reduced:	NSiC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	511.293388
ΔH_f, kcal/mol:	-33.36
Dipole, Da:	1.45
IP(EA), eV:	-8.73(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[4-[(4-dodecanoyl-2-methoxycarbonyloxypyrrol-1-yl)methyl]phenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CCC1(CC=CC=C1)N[Si](C)(C)C

DOS

IR

Vibrations