Geometry & MOs

Info

ID:	145165
PubChem CID:	53473408
Reduced:	N2H18C25 (1)
Stoich.:	A2B18C25 (1)
Weight, g/mol:	637.19003
ΔH_f, kcal/mol:	135.23
Dipole, Da:	3.26
IP(EA), eV:	-8.13(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,4S)-2-iodo-4-[(4-methoxyphenyl)methoxy]-1-[(2R)-1-[(4-methoxyphenyl)methoxy]propan-2-yl]-3-methylcyclopent-2-en-1-yl] N,N-diethylcarbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4C#N

DOS

IR

Vibrations