Geometry & MOs

Info

ID:	414984
PubChem CID:	135087964
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	-55.74
Dipole, Da:	7.89
IP(EA), eV:	-9.1(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2OC)CC3=CC=C(C=C3)C(=O)NC

DOS

IR

Vibrations