Geometry & MOs

Info

ID:	135251
PubChem CID:	51840601
Reduced:	N2O7C20H26 (1)
Stoich.:	A2B7C20D26 (1)
Weight, g/mol:	424.172225
ΔH_f, kcal/mol:	-288.45
Dipole, Da:	4.16
IP(EA), eV:	-8.83(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-4-methyl-2-[[(4S)-4-(2,3,4-trifluorophenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl]amino]pentanoate

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN([C@H](C2=C(C=C(C=C2O)O)O)C(=O)NC(C)(C)C)C(=O)CO

DOS

IR

Vibrations