Geometry & MOs

Info

ID:	282502
PubChem CID:	103928947
Reduced:	N3O3C14H23 (1)
Stoich.:	A3B3C14D23 (1)
Weight, g/mol:	289.215413
ΔH_f, kcal/mol:	-128.17
Dipole, Da:	3.27
IP(EA), eV:	-8.49(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3,3-dimethyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)NC1=CN(C(=O)C=C1)CCOC)N

DOS

IR

Vibrations