Geometry & MOs

Info

ID:	133832
PubChem CID:	51597296
Reduced:	O2N5C23H33 (1)
Stoich.:	A2B5C23D33 (1)
Weight, g/mol:	380.173607
ΔH_f, kcal/mol:	-59.13
Dipole, Da:	8.28
IP(EA), eV:	-8.94(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-2H-chromen-6-yl)-N-[(3R)-1-(2-methoxyphenyl)-5-oxopyrrolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C=NN(C2=N1)C(C)C)C(=O)N3CCC[C@H](C3)C(=O)N4CCCCCC4

DOS

IR

Vibrations