Geometry & MOs

Info

ID:	420880
PubChem CID:	135114982
Reduced:	NO2C19H29 (1)
Stoich.:	AB2C19D29 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-99.88
Dipole, Da:	2.59
IP(EA), eV:	-8.58(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R,4R)-3-hydroxy-4-(pyridin-4-ylmethyl)pyrrolidine-1-carbonyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCCN(C)C2C[C@@H]3CC(C[C@@H]3C2)O)C

DOS

IR

Vibrations