Geometry & MOs

Info

ID:	371247
PubChem CID:	127344468
Reduced:	O2N4C19H32 (1)
Stoich.:	A2B4C19D32 (1)
Weight, g/mol:	387.299811
ΔH_f, kcal/mol:	-112.52
Dipole, Da:	6.68
IP(EA), eV:	-8.67(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-4-pyrrolidin-1-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1CCN(CC1)C(=O)NC2CCC3=NC(=CN3C2)C(C)(C)C)O

DOS

IR

Vibrations