Geometry & MOs

Info

ID:	423315
PubChem CID:	135119301
Reduced:	O2N3C17H25 (1)
Stoich.:	A2B3C17D25 (1)
Weight, g/mol:	371.184506
ΔH_f, kcal/mol:	-46.61
Dipole, Da:	5.12
IP(EA), eV:	-8.65(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-4-benzyl-3-hydroxy-1-[3-(2-methylimidazol-1-yl)propanoyl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1C)OC)CN(CCO)CC2=CN=CN2C

DOS

IR

Vibrations