Geometry & MOs

Info

ID:	447233
PubChem CID:	135281355
Reduced:	N2O4C25H46 (1)
Stoich.:	A2B4C25D46 (1)
Weight, g/mol:	457.152537
ΔH_f, kcal/mol:	-249.24
Dipole, Da:	6.71
IP(EA), eV:	-9.94(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[9H-fluoren-9-ylmethoxycarbonyl(prop-2-enoyl)amino]-3-(4-hydroxyphenyl)propanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)NC(CCCCNC(=O)C=C)C(=O)O

DOS

IR

Vibrations