Geometry & MOs

Info

ID:	210281
PubChem CID:	80784276
Reduced:	ON6C10H18 (1)
Stoich.:	AB6C10D18 (1)
Weight, g/mol:	270.184447
ΔH_f, kcal/mol:	-24.12
Dipole, Da:	2.0
IP(EA), eV:	-8.65(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(cyclopentylmethyl)-2-N-ethylquinazoline-2,4-diamine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)N)NCC(=O)NC

DOS

IR

Vibrations