Geometry & MOs

Info

ID:	423760
PubChem CID:	135120166
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	363.158292
ΔH_f, kcal/mol:	-77.92
Dipole, Da:	5.5
IP(EA), eV:	-9.14(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrrol-2-yl)-2-oxo-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CCCNC(=O)C2=NN3CC(CNC(=O)C3=C2)O

DOS

IR

Vibrations