Geometry & MOs

Info

ID:	441156
PubChem CID:	135233359
Reduced:	O2N8C23H36 (1)
Stoich.:	A2B8C23D36 (1)
Weight, g/mol:	426.31071
ΔH_f, kcal/mol:	0.95
Dipole, Da:	3.99
IP(EA), eV:	-8.6(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[5-(2,2-dimethylpropylamino)-6-(methylamino)pyridin-2-yl]-2,2-dimethylcyclohexyl]-5-methyl-1H-imidazole-2-carboxamide

Drug info:

PubChemData

Smile

CC1(CCC(CC1NC(=O)CN2C=NC=N2)C3=NC(=C(C=C3)NCC(C)(C)C)N(C)N=O)C

DOS

IR

Vibrations