Geometry & MOs

Info

ID:	222708
PubChem CID:	85332049
Reduced:	FN2O7H23C25 (1)
Stoich.:	AB2C7D23E25 (1)
Weight, g/mol:	482.314458
ΔH_f, kcal/mol:	-247.91
Dipole, Da:	5.05
IP(EA), eV:	-8.94(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[2-amino-5-[3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]phenyl]pentanoate

Drug info:

PubChemData

Smile

CC(C(C)OC1=CC(=C(C=C1)CNC(=O)C2=C(N=CC=C2)OC3=CC4=C(C=C3)OCO4)F)C(=O)O

DOS

IR

Vibrations