Geometry & MOs

Info

ID:	418853
PubChem CID:	135106959
Reduced:	N7C18H29 (1)
Stoich.:	A7B18C29 (1)
Weight, g/mol:	378.106099
ΔH_f, kcal/mol:	38.63
Dipole, Da:	1.42
IP(EA), eV:	-8.7(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R,4R)-1-(2,6-difluoro-4-methoxybenzoyl)-4-hydroxypyrrolidin-3-yl]-N,N-dimethylmethanesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC(=NC(=N1)N2CCCCC2)NCCCN3C(=NC(=N3)C)C

DOS

IR

Vibrations