Geometry & MOs

Info

ID:	77567
PubChem CID:	49655496
Reduced:	N3O5H15C16 (1)
Stoich.:	A3B5C15D16 (1)
Weight, g/mol:	458.091246
ΔH_f, kcal/mol:	-150.87
Dipole, Da:	2.3
IP(EA), eV:	-9.09(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[4-(2,3-dichlorophenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl]amino]-4-methylbenzoate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC(=C1)NC(=O)C(=O)NCC2=CC=NC=C2)O

DOS

IR

Vibrations