Geometry & MOs

Info

ID:	423631
PubChem CID:	135119876
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	389.177313
ΔH_f, kcal/mol:	-68.95
Dipole, Da:	5.77
IP(EA), eV:	-9.14(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]piperidine-1-sulfonamide

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@H]1C(=O)O)O)CC2=CC=C(C=C2)N3C=CC=N3

DOS

IR

Vibrations