Geometry & MOs

Info

ID:	328538
PubChem CID:	126724368
Reduced:	N3O6C26H27 (1)
Stoich.:	A3B6C26D27 (1)
Weight, g/mol:	436.199822
ΔH_f, kcal/mol:	-192.76
Dipole, Da:	2.09
IP(EA), eV:	-9.15(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-[[5-(dihydroxymethyl)-1-methylpyrrole-3-carbonyl]amino]-2-methyl-5-(4-phenylphenyl)pentanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C)CC(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C3=NC(=O)NC(=C3)C(=O)O

DOS

IR

Vibrations