Geometry & MOs

Info

ID:	414334
PubChem CID:	135087290
Reduced:	N2O3C18H30 (1)
Stoich.:	A2B3C18D30 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	-177.84
Dipole, Da:	2.37
IP(EA), eV:	-9.27(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-pyrazol-4-yl)-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]butanamide

Drug info:

PubChemData

Smile

C1CCN(C(=O)C1)CCCC(=O)N2CCC[C@@]3(C2)CCC[C@H]3O

DOS

IR

Vibrations