Geometry & MOs

Info

ID:	243619
PubChem CID:	99233422
Reduced:	N2O4C27H36 (1)
Stoich.:	A2B4C27D36 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	-161.87
Dipole, Da:	6.3
IP(EA), eV:	-8.91(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-5-[(2R)-2-(3,4-dimethylphenyl)pyrrolidine-1-carbonyl]furan-2-sulfonamide

Drug info:

PubChemData

Smile

CCCCN1[C@H]([C@@H](CCC1=O)C(=O)NC2=CC=CC(=C2)COC(C)C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations