Geometry & MOs

Info

ID:	304118
PubChem CID:	124495176
Reduced:	N3C19H25 (1)
Stoich.:	A3B19C25 (1)
Weight, g/mol:	425.231456
ΔH_f, kcal/mol:	39.45
Dipole, Da:	1.15
IP(EA), eV:	-8.25(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2R)-2-[6-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyridin-3-yl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)CN1CCC[C@H]1C2=C(N=CC=C2)NC3=CC=CC=C3

DOS

IR

Vibrations