Geometry & MOs

Info

ID:	416543
PubChem CID:	135089596
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	345.151098
ΔH_f, kcal/mol:	-51.54
Dipole, Da:	6.13
IP(EA), eV:	-9.17(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CNC(=O)CN2C[C@H]([C@@H](C2)O)CC3=NNC(=C3)C

DOS

IR

Vibrations